Home Halogens 1-(2-bromo-5-methyl-1,3-thiazol-4-yl)ethan-1-one

1-(2-bromo-5-methyl-1,3-thiazol-4-yl)ethan-1-one

CAS No.:
1280703-71-0
Catalog Number:
AG01C17Q
Molecular Formula:
C6H6BrNOS
Molecular Weight:
220.0869
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Product Description
Catalog Number:
AG01C17Q
Chemical Name:
1-(2-bromo-5-methyl-1,3-thiazol-4-yl)ethan-1-one
CAS Number:
1280703-71-0
Molecular Formula:
C6H6BrNOS
Molecular Weight:
220.0869
MDL Number:
MFCD23132036
IUPAC Name:
1-(2-bromo-5-methyl-1,3-thiazol-4-yl)ethanone
InChI:
InChI=1S/C6H6BrNOS/c1-3(9)5-4(2)10-6(7)8-5/h1-2H3
InChI Key:
OBLRYUORPVWFAI-UHFFFAOYSA-N
SMILES:
Brc1sc(c(n1)C(=O)C)C
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.935g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.084g/mol
Monoisotopic Mass:
218.935g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties